2,3-dihydro-1-benzofuran-5-yl-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: 2,3-dihydro-1-benzofuran-5-yl-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: 2,3-dihydrobenzofuran-5-yl-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: 2,3-dihydrobenzofuran-5-yl-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1-benzofuran-5-yl-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: coumaran-5-yl-[4-(3-nitrophenyl)sulfonylpiperazino]methanone Formula: C19H19N3O6S MolecularWeight: 417.43566

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C1C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O6S/c23-19(15-4-5-18-14(12-15)6-11-28-18)20-7-9-21(10-8-20)29(26,27)17-3-1-2-16(13-17)22(24)25/h1-5,12-13H,6-11H2